N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide
TL;DR: N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide (CAS 489406-48-6) is a chemical compound with molecular formula C12H12BrN3O and molecular weight 293.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromo-2-methylphenyl)-2-methylpyrazole-3-carboxamide
Also Known As: N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide, 2-Methyl-2H-pyrazole-3-carboxylic acid (4-bromo-2-methyl-phenyl)-amide, A1-26180, N-(4-bromo-2-methylphenyl)-2-methylpyrazole-3-carboxamide, N-(4-bromo-2-methyl-phenyl)-2-methyl-pyrazole-3-carboxamide
| Molecular Formula | C12H12BrN3O |
|---|---|
| Molecular Weight | 293.02 g/mol |
| LogP | 2.74332 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.01636 |
| Heavy Atoms | 17 |
| Complexity | 562.6284 |
Chemical Identifiers
| CAS Number | 489406-48-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Br)NC(=O)C2=CC=NN2C |
Product Overview
N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide (CAS 489406-48-6), with molecular formula C12H12BrN3O and molecular weight 293.02 g/mol. IUPAC: N-(4-bromo-2-methylphenyl)-2-methylpyrazole-3-carboxamide.
Chemical Property Profile of N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide
Property Insights of N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide
The XLogP value of 2.74332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide. With a topological polar surface area (TPSA) of 46.92 Ų, N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide?
The CAS number of N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide is 489406-48-6.
What is the molecular formula of N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide?
The molecular formula of N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide is C12H12BrN3O.
What is the molecular weight of N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide?
The molecular weight of N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide is 293.02 g/mol.
Where can I buy N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide?
You can request a quote for N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromo-2-methylphenyl)-1-methyl-1H-pyrazole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.